17 results on '"Xie, Xiang‐Qun"'
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2. DAKB-GPCRs: An Integrated Computational Platform for Drug Abuse Related GPCRs
3. Development and Testing of Druglike Screening Libraries
4. ProSelection: A Novel Algorithm to Select Proper Protein Structure Subsets for in Silico Target Identification and Drug Discovery Research
5. StemCellCKB: An Integrated Stem Cell-Specific Chemogenomics KnowledgeBase for Target Identification and Systems-Pharmacology Research
6. Difference and Influence of Inactive and Active States of Cannabinoid Receptor Subtype CB2: From Conformation to Drug Discovery
7. Development and Testing of Druglike Screening Libraries
8. Structural Insight into Tetrameric hTRPV1 from Homology Modeling, Molecular Docking, Molecular Dynamics Simulation, Virtual Screening, and Bioassay Validations
9. Modeling, Molecular Dynamics Simulation, and Mutation Validation for Structure of Cannabinoid Receptor 2 Based on Known Crystal Structures of GPCRs
10. AlzPlatform: An Alzheimer’s Disease Domain-Specific Chemogenomics Knowledgebase for Polypharmacology and Target Identification Research
11. LiCABEDS II. Modeling of Ligand Selectivity for G-Protein-Coupled Cannabinoid Receptors
12. GPU Accelerated Chemical Similarity Calculation for Compound Library Comparison
13. Residue Preference Mapping of Ligand Fragments in the Protein Data Bank
14. Ligand Classifier of Adaptively Boosting Ensemble Decision Stumps (LiCABEDS) and Its Application on Modeling Ligand Functionality for 5HT-Subtype GPCR Families
15. Data Mining a Small Molecule Drug Screening Representative Subset from NIH PubChem
16. GPCR Structure-Based Virtual Screening Approach for CB2 Antagonist Search
17. Genetic Algorithm-Optimized QSPR Models for Bioavailability, Protein Binding, and Urinary Excretion
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